SCHEMBL7534665

SCHEMBL7534665

CC(C)CCCCCCCc1ccc(N)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.55
GFER P55789 1/20 0.50
HTR2A P28223 1/20 0.47
TDP1 Q9NUW8 2/20 0.44
MAOA P21397 2/20 0.43
FUT7 Q11130 1/20 0.41
ALDH1A1 P00352 3/20 0.40
KDM4E B2RXH2 2/20 0.40
HSD17B10 Q99714 2/20 0.40
HIF1A Q16665 2/20 0.40
MEN1 O00255 1/20 0.40
USP2 O75604 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
HPGD P15428 1/20 0.40
RAB9A P51151 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
EPAS1 Q99814 1/20 0.40
CYP3A4 P08684 2/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL10597101 1.00 MAOB (0.55) MAOBGFERHTR2ATDP1MAOA
SCHEMBL18266026 1.00 MAOB (0.55) MAOBGFERHTR2ATDP1MAOA
SCHEMBL11359238 1.00 MAOB (0.55) MAOBGFERHTR2ATDP1MAOA
SCHEMBL1311845 1.00 MAOB (0.55) MAOBGFERHTR2ATDP1MAOA
Hydrochloric Acid SCHEMBL11413102 0.98 MAOB (0.57) MAOBGFERHTR2ATDP1MAOA
SCHEMBL11244317 0.92 GFER (0.54) MAOBGFERHTR2ATDP1MAOA
Hydrogen Peroxide SCHEMBL29262757 0.85 GRIN2D (0.49) FUT7ALDH1A1KDM4EHSD17B10HIF1A
SCHEMBL2408286 0.83 GFER (0.59) MAOBGFERTDP1MAOAALDH1A1
SCHEMBL4021564 0.82 MAOB (0.76) MAOBGFERHTR2ATDP1MAOA
SCHEMBL4020067 0.82 MAOB (0.76) MAOBGFERHTR2ATDP1MAOA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1097188-B1 USE OF AMINO AZOIC DYES AS MARKERS OF OIL DISTILLATION PRODUCTS SIAC IT ADDITIVI CARBURANTI (IT) 2002-04-10 EP disclosed
US-6339145-B1 ADDING TO OIL DISTILLATION PRODUCTS AN AMINO AZOIC DYE COMPOUND SOCIETA' ITALIANA ADDITIVI PER CARBURANTI S.R.L. (IT) 2002-01-15 US disclosed
EP-1097188-A1 USE OF AMINO AZOIC DYES AS MARKERS OF OIL DISTILLATION PRODUCTS SOCIETA' ITALIANA ADDITIVI PER CARBURANTI S.r.l. (IT) 2001-05-09 EP disclosed
WO-1999067346-A1 USE OF AMINO AZOIC DYES AS MARKERS OF OIL DISTILLATION PRODUCTS SOCIETA' ITALIANA ADDITIVI PER CARBURANTI S.R.L. (IT) 1999-12-29 WO disclosed